(Z)-2-cyano-3-[3-[2-(4-ethylphenoxy)ethoxy]-4-methoxy-phenyl]prop-2-enoic acid

Systemtic Name: (Z)-2-cyano-3-[3-[2-(4-ethylphenoxy)ethoxy]-4-methoxy-phenyl]prop-2-enoic acid Openeye Name: (Z)-2-cyano-3-[3-[2-(4-ethylphenoxy)ethoxy]-4-methoxy-phenyl]prop-2-enoic acid CAS Name: (Z)-2-cyano-3-[3-[2-(4-ethylphenoxy)ethoxy]-4-methoxyphenyl]-2-propenoic acid IUPAC Name: (Z)-2-cyano-3-[3-[2-(4-ethylphenoxy)ethoxy]-4-methoxyphenyl]prop-2-enoic acid Traditional Name: (Z)-2-cyano-3-[3-[2-(4-ethylphenoxy)ethoxy]-4-methoxy-phenyl]acrylic acid Formula: C21H21NO5 MolecularWeight: 367.39514

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCCOC2=C(C=CC(=C2)C=C(C#N)C(=O)O)OC

Isomeric SMILES

CCC1=CC=C(C=C1)OCCOC2=C(C=CC(=C2)/C=C(/C#N)\C(=O)O)OC

InChI

InChI=1S/C21H21NO5/c1-3-15-4-7-18(8-5-15)26-10-11-27-20-13-16(6-9-19(20)25-2)12-17(14-22)21(23)24/h4-9,12-13H,3,10-11H2,1-2H3,(H,23,24)/b17-12-